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Generalized-ensemble simulations of all-atom protein models

Vasyl Aleksenko, Wooseop Kwak and Ulrich H.E. Hansmann

Physica A: Statistical Mechanics and its Applications, 2005, vol. 350, issue 1, 28-37

Abstract: We review recent progress in generalized-ensemble simulations of proteins. Focusing on the formation of secondary structure, we show how these techniques can lead to a deeper understanding of the folding mechanism in proteins.

Keywords: Generalized-ensemble simulations; Protein folding; α→β transitions (search for similar items in EconPapers)
Date: 2005
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Persistent link: https://EconPapers.repec.org/RePEc:eee:phsmap:v:350:y:2005:i:1:p:28-37

DOI: 10.1016/j.physa.2004.11.027

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Physica A: Statistical Mechanics and its Applications is currently edited by K. A. Dawson, J. O. Indekeu, H.E. Stanley and C. Tsallis

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